methyl 3-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propanoate

Systemtic Name: methyl 3-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propanoate Openeye Name: methyl 3-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propanoate CAS Name: 3-(4-benzofuro[3,2-d]pyrimidinylthio)propanoic acid methyl ester IUPAC Name: methyl 3-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propanoate Traditional Name: 3-(benzofuro[3,2-d]pyrimidin-4-ylthio)propionic acid methyl ester Formula: C14H12N2O3S MolecularWeight: 288.32168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NC=NC2=C1OC3=CC=CC=C32

Isomeric SMILES

COC(=O)CCSC1=NC=NC2=C1OC3=CC=CC=C32

InChI

InChI=1S/C14H12N2O3S/c1-18-11(17)6-7-20-14-13-12(15-8-16-14)9-4-2-3-5-10(9)19-13/h2-5,8H,6-7H2,1H3